N-[1-(1-adamantyl)propyl]-4-[(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)methyl]thiophene-2-carboxamide

Systemtic Name: N-[1-(1-adamantyl)propyl]-4-[(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)methyl]thiophene-2-carboxamide Openeye Name: N-[1-(1-adamantyl)propyl]-4-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]thiophene-2-carboxamide CAS Name: N-[1-(1-adamantyl)propyl]-4-[(4-chloro-3,5-dimethyl-1-pyrazolyl)methyl]-2-thiophenecarboxamide IUPAC Name: N-[1-(1-adamantyl)propyl]-4-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]thiophene-2-carboxamide Traditional Name: N-[1-(1-adamantyl)propyl]-4-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]thiophene-2-carboxamide Formula: C24H32ClN3OS MolecularWeight: 446.04838

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC(=CS4)CN5C(=C(C(=N5)C)Cl)C

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC(=CS4)CN5C(=C(C(=N5)C)Cl)C

InChI

InChI=1S/C24H32ClN3OS/c1-4-21(24-9-16-5-17(10-24)7-18(6-16)11-24)26-23(29)20-8-19(13-30-20)12-28-15(3)22(25)14(2)27-28/h8,13,16-18,21H,4-7,9-12H2,1-3H3,(H,26,29)